1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol

C11H18N2O2 — CID 65091967

IUPAC1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol
SMILESCOCCCC(O)Cc1ccnc(N)c1
InChIInChI=1S/C11H18N2O2/c1-15-6-2-3-10(14)7-9-4-5-13-11(12)8-9/h4-5,8,10,14H,2-3,6-7H2,1H3,(H2,12,13)
InChIKeyIQGYMBWJTBYYLW-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.99
Rot. Bonds6

About 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol

1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol (PubChem CID 65091967) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol.

Molecular Properties

Compound Name1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol
PubChem CID65091967
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol
SMILESCOCCCC(O)Cc1ccnc(N)c1
InChIInChI=1S/C11H18N2O2/c1-15-6-2-3-10(14)7-9-4-5-13-11(12)8-9/h4-5,8,10,14H,2-3,6-7H2,1H3,(H2,12,13)
InChIKeyIQGYMBWJTBYYLW-UHFFFAOYSA-N
XLogP0.99
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-[5-methoxy-2-(methylamino)pentyl]pyridin-2-amine
CID 65091866
1-(2-amino-4-pyridinyl)-5-methylsulfanylpentan-2-ol
CID 103089951
1-(2-amino-4-pyridinyl)-4-(diethylamino)butan-2-ol
CID 79087656
1-(3-chlorophenyl)-5-methoxypentan-2-ol
CID 62608166
1-(4-bromophenyl)-5-methoxypentan-2-ol
CID 62608729
1-(3,5-difluorophenyl)-5-methoxypentan-2-ol
CID 115601584
1-(3-bromo-4-fluorophenyl)-5-methoxypentan-2-ol
CID 65092433
2-(2-amino-4-pyridinyl)-1-(6-methoxypyrimidin-4-yl)ethanol
CID 102950454
3-(2-amino-4-pyridinyl)-1,1-difluoropropan-2-ol
CID 112575631
4-(2-amino-3-methoxybutyl)pyridin-2-amine
CID 79615950
4-(2-methoxyethylsulfanylmethyl)pyridin-2-amine
CID 62468388
4-(2-amino-4-ethoxybutyl)pyridin-2-amine
CID 106815067

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol?
The IUPAC name of 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol (CID 65091967) is 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol.
What is the SMILES notation for 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol?
The canonical SMILES for 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol is COCCCC(O)Cc1ccnc(N)c1.
What is the InChIKey of 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol?
The InChIKey is IQGYMBWJTBYYLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-15-6-2-3-10(14)7-9-4-5-13-11(12)8-9/h4-5,8,10,14H,2-3,6-7H2,1H3,(H2,12,13).
What are the key properties of 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol?
1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol has a molecular weight of 210.28 g/mol, XLogP of 0.99, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-4-pyridinyl)-5-methoxypentan-2-ol is sourced from PubChem (CID 65091967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).